5-amino-2,3-dichlorobenzamide

C7H6Cl2N2O — CID 107183127

IUPAC5-amino-2,3-dichlorobenzamide
SMILESNC(=O)c1cc(N)cc(Cl)c1Cl
InChIInChI=1S/C7H6Cl2N2O/c8-5-2-3(10)1-4(6(5)9)7(11)12/h1-2H,10H2,(H2,11,12)
InChIKeyDCPIRIJJVQUTLA-UHFFFAOYSA-N
MW205.04 g/mol
LogP1.67
Rot. Bonds1

About 5-amino-2,3-dichlorobenzamide

5-amino-2,3-dichlorobenzamide (PubChem CID 107183127) has the molecular formula C7H6Cl2N2O and a molecular weight of 205.04 g/mol. Its IUPAC name is 5-amino-2,3-dichlorobenzamide.

Molecular Properties

Compound Name5-amino-2,3-dichlorobenzamide
PubChem CID107183127
Molecular FormulaC7H6Cl2N2O
Molecular Weight205.04 g/mol
Exact Mass203.99
IUPAC Name5-amino-2,3-dichlorobenzamide
SMILESNC(=O)c1cc(N)cc(Cl)c1Cl
InChIInChI=1S/C7H6Cl2N2O/c8-5-2-3(10)1-4(6(5)9)7(11)12/h1-2H,10H2,(H2,11,12)
InChIKeyDCPIRIJJVQUTLA-UHFFFAOYSA-N
XLogP1.67
TPSA69.11 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.04
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

(5-amino-2,3-dichlorophenyl)-[(3R,4S)-3,4-dihydroxypyrrolidin-1-yl]methanone
CID 107210976
5-amino-3-chloro-2-(ethylamino)benzamide
CID 107192494
5-amino-2,3-dichloro-N-methyl-N-prop-2-enylbenzamide
CID 107185667
5-amino-3-chloro-2-(cyclopropylamino)benzamide
CID 107192447
4-amino-2,6-dichlorophenol;urea
CID 154637850
5-amino-3-chloro-2-(3-methylbutan-2-yloxy)benzamide
CID 107198027
2-ethylbutyl 5-amino-2,3-dichlorobenzoate
CID 107199210
5-amino-3-chloro-2-(2-chlorophenoxy)benzamide
CID 107197235
5-amino-2,3-dichloro-N-[2-(methylamino)-2-oxoethyl]benzamide
CID 107183561
4-methylpentan-2-yl 5-amino-2,3-dichlorobenzoate
CID 107198902
5-amino-2,3-dichloro-N-[(2R)-2-hydroxypropyl]benzamide
CID 107211060
5-amino-3-chloro-2-(2,4,6-trimethylanilino)benzamide
CID 107192577

Frequently Asked Questions

What is the IUPAC name of 5-amino-2,3-dichlorobenzamide?
The IUPAC name of 5-amino-2,3-dichlorobenzamide (CID 107183127) is 5-amino-2,3-dichlorobenzamide.
What is the SMILES notation for 5-amino-2,3-dichlorobenzamide?
The canonical SMILES for 5-amino-2,3-dichlorobenzamide is NC(=O)c1cc(N)cc(Cl)c1Cl.
What is the InChIKey of 5-amino-2,3-dichlorobenzamide?
The InChIKey is DCPIRIJJVQUTLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6Cl2N2O/c8-5-2-3(10)1-4(6(5)9)7(11)12/h1-2H,10H2,(H2,11,12).
What are the key properties of 5-amino-2,3-dichlorobenzamide?
5-amino-2,3-dichlorobenzamide has a molecular weight of 205.04 g/mol, XLogP of 1.67, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2,3-dichlorobenzamide is sourced from PubChem (CID 107183127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).